ethyl 2-(phenylcarbonyl)-3-[(E)-2-(phenylsulfonyl)ethenyl]nonanoate

Systemtic Name: ethyl 2-(phenylcarbonyl)-3-[(E)-2-(phenylsulfonyl)ethenyl]nonanoate Openeye Name: ethyl 3-[(E)-2-(benzenesulfonyl)vinyl]-2-benzoyl-nonanoate CAS Name: 3-[(E)-2-(benzenesulfonyl)ethenyl]-2-benzoylnonanoic acid ethyl ester IUPAC Name: ethyl 3-[(E)-2-(benzenesulfonyl)ethenyl]-2-benzoylnonanoate Traditional Name: (E)-2-benzoyl-5-besyl-3-hexyl-pent-4-enoic acid ethyl ester Formula: C26H32O5S MolecularWeight: 456.59428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C=CS(=O)(=O)C1=CC=CC=C1)C(C(=O)C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCCCCCC(/C=C/S(=O)(=O)C1=CC=CC=C1)C(C(=O)C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C26H32O5S/c1-3-5-6-9-14-21(19-20-32(29,30)23-17-12-8-13-18-23)24(26(28)31-4-2)25(27)22-15-10-7-11-16-22/h7-8,10-13,15-21,24H,3-6,9,14H2,1-2H3/b20-19+